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306980-26-7

306980-26-7 structural image
Product Name: ETHYL 5-CYANO-6-([2-(METHOXYCARBONYL)PHENYL]SULFANYL)-2-PHENYLNICOTINATE
Formula: C23H18N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 418.5 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 418.09872823 g/mol
Monoisotopic Mass 418.09872823 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 642
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes